SMILES:
COc1cc(C2CCC(OCCCN)O2)cc(OC)c1OCMolecular Processing
Molecular formula
C16H25NO5
Molecular weight
311.38
Exact mass
311.1733
XLogP
2.26
TPSA
72.17
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
82.57
Supplementary Information
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